Chem
J-GLOBAL ID：200907014762623740   Nikkaji number：J247.893E

Labdane

ラブダン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H38
Molecular formula furigana： C20-H38
Molecular weight： 278.524
InChI： InChI=1S/C20H38/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h15-18H,7-14H2,1-6H3/t15-,16+,17+,18+,20-/m1/s1
InChI key： LEWJAHURGICVRE-AISVETHESA-N
SMILES： CC[C@@H](C)CC[C@H]1[C@@H](C)CC[C@H]2C(C)(C)CCC[C@]12C
Systematic name  (3)：
  • ラブダン
  • (4aR,5S,6S,8aS)-1,1,4a,6-テトラメチル-5-[(3R)-3-メチルペンチル]-デカヒドロナフタレン
  • (4aR,5S,6S,8aS)-1,1,4a,6-tetramethyl-5-[(3R)-3-methylpentyl]-decahydronaphthalene
Other name (1)：
  • Labdane
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